Name: Name:2,3,4,5-TETRA-O-ACETYL-D-XYLONITRILE
Brand: Angene
SKU: AG009G9L
Rating: 90 (10 reviews)

2,3,4,5-TETRA-O-ACETYL-D-XYLONITRILE

CAS No.:

13501-95-6

Catalog Number:

AG009G9L

Molecular Formula:

C13H17NO8

Molecular Weight:

315.2760

Catalog Number:

AG009G9L

Chemical Name:

2,3,4,5-TETRA-O-ACETYL-D-XYLONITRILE

CAS Number:

13501-95-6

Molecular Formula:

C13H17NO8

Molecular Weight:

315.2760

MDL Number:

MFCD00275250

IUPAC Name:

[(2R,3R,4S)-2,3,4-triacetyloxy-4-cyanobutyl] acetate

InChI:

InChI=1S/C13H17NO8/c1-7(15)19-6-12(21-9(3)17)13(22-10(4)18)11(5-14)20-8(2)16/h11-13H,6H2,1-4H3/t11-,12+,13+/m0/s1

InChI Key:

YHTPKBYAZJOQCI-YNEHKIRRSA-N

SMILES:

N#C[C@@H]([C@H]([C@H](OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C

Complexity:

492

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

315.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

315.278g/mol

Monoisotopic Mass:

315.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

129A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.3